Substitution and chemical environment effects on the absorption spectrum of indigo.
作者： Denis Jacquemin , Julien Preat , Valérie Wathelet , Eric A. Perpète
DOI: 10.1063/1.2166018
关键词: Spectral line 、 Ab initio quantum chemistry methods 、 Computational chemistry 、 Analytical chemistry 、 Ab initio 、 Absorption (chemistry) 、 Chemistry 、 Polarizable continuum model 、 Absorption spectroscopy 、 Indigo 、 Solvent effects
摘要: … In the early times of organic chemistry, huge “dye effort” motivated by industrial applications have been achieved, leading to the synthesis of indigo and indoxyle, its precursor, by Bayer …
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sci-hub.se 参考文章(86)
A. Gonis, M. Ciftan, N. Kioussis, Electron Correlations and Materials Properties ,(2013)
M. Klessinger, Theoretische und spektroskopische untersuchungen an indigo-farbstoffen — II Tetrahedron. ,vol. 22, pp. 3355- 3365 ,(1963) , 10.1016/S0040-4020(01)92523-2
M. Klessinger, W. Lüttke, Theoretische und spektroskopische untersuchungen an indigo-farbstoffen — II Tetrahedron. ,vol. 19, pp. 315- 335 ,(1963) , 10.1016/S0040-4020(63)80023-X
Jeanette G. Grasselli, CRC atlas of spectral data and physical constants for organic compounds ,(1973)
Claudio Amovilli, Vincenzo Barone, Roberto Cammi, Eric Cancès, Maurizio Cossi, Benedetta Mennucci, Christian S. Pomelli, Jacopo Tomasi, Recent Advances in the Description of Solvent Effects with the Polarizable Continuum Model Advances in Quantum Chemistry. ,vol. 32, pp. 227- 261 ,(1998) , 10.1016/S0065-3276(08)60416-5
Denis Jacquemin, Julien Preat, Magali Charlot, Valérie Wathelet, Jean-Marie André, Eric A. Perpète, Theoretical investigation of substituted anthraquinone dyes The Journal of Chemical Physics. ,vol. 121, pp. 1736- 1743 ,(2004) , 10.1063/1.1764497
Roberto Improta, Vincenzo Barone, Absorption and fluorescence spectra of uracil in the gas phase and in aqueous solution: a TD-DFT quantum mechanical study. Journal of the American Chemical Society. ,vol. 126, pp. 14320- 14321 ,(2004) , 10.1021/JA0460561
Studies in enzyme cytochemistry. III. Relationships between solubility, molecular association and structure in indigoid dyes. Proceedings of The Royal Society B: Biological Sciences. ,vol. 148, pp. 495- 505 ,(1958) , 10.1098/RSPB.1958.0041
Anna Masternak, Grazyna Wenska, Jan Milecki, Bohdan Skalski, Stefan Franzen, Solvatochromism of a Novel Betaine Dye Derived from Purine Journal of Physical Chemistry A. ,vol. 109, pp. 759- 766 ,(2005) , 10.1021/JP047098E
P. Friedländer, Ueber schwefelhaltige Analoga der Indigogruppe Berichte der deutschen chemischen Gesellschaft. ,vol. 39, pp. 1060- 1066 ,(1906) , 10.1002/CBER.190603901167